{"id":"https://openalex.org/W2240477367","doi":null,"title":"Failure of hybrid functionals to predict band gaps of materials at nanoscale","display_name":"Failure of hybrid functionals to predict band gaps of materials at nanoscale","publication_year":2014,"publication_date":"2014-03-03","ids":{"openalex":"https://openalex.org/W2240477367","mag":"2240477367"},"language":"en","primary_location":{"id":"mag:2240477367","doi":null,"is_oa":false,"landing_page_url":"http://absimage.aps.org/image/MAR14/MWS_MAR14-2013-003883.pdf","pdf_url":null,"source":{"id":"https://openalex.org/S2764664775","display_name":"Bulletin of the American Physical Society","issn_l":"0003-0503","issn":["0003-0503"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core"],"host_organization":"https://openalex.org/P4310311721","host_organization_name":"Cambridge University Press","host_organization_lineage":["https://openalex.org/P4310311721","https://openalex.org/P4310311702"],"host_organization_lineage_names":["Cambridge University Press","University of Cambridge"],"type":"journal"},"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false,"raw_source_name":"Bulletin of the American Physical Society","raw_type":null},"volume":null,"type":"article","is_traditional":true,"indexed_in":[],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5101811742","display_name":"Xinquan Wang","orcid":"https://orcid.org/0009-0005-9986-7054","observed_orcids":["https://orcid.org/0009-0005-9986-7054","https://orcid.org/0009-0003-8346-7123"]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Xinquan Wang","raw_affiliation_strings":[],"raw_orcid":"https://orcid.org/0009-0005-9986-7054","affiliations":[]},{"author_position":"last","author":{"id":"https://openalex.org/A5104165372","display_name":"Zhigang Wu","orcid":"https://orcid.org/0009-0007-3269-0375","observed_orcids":["https://orcid.org/0009-0007-3269-0375"]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Zhigang Wu","raw_affiliation_strings":[],"raw_orcid":"https://orcid.org/0009-0007-3269-0375","affiliations":[]}],"institutions":[],"countries_distinct_count":0,"institutions_distinct_count":0,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.0,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"2014","issue":null,"first_page":null,"last_page":null},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10002","display_name":"Advanced Chemical Physics Studies","score":0.9945999979972839,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10002","display_name":"Advanced Chemical Physics Studies","score":0.9945999979972839,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.003000000026077032,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10275","display_name":"2D Materials and Applications","score":0.000699999975040555,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/hybrid-functionals","display_name":"hybrid functionals","score":0.9909999966621399},{"id":"https://openalex.org/keywords/band-gap","display_name":"band gap","score":0.8700000047683716},{"id":"https://openalex.org/keywords/nanoscale-materials","display_name":"nanoscale materials","score":0.9369999766349792},{"id":"https://openalex.org/keywords/density-functional-theory","display_name":"density functional theory","score":0.7409999966621399},{"id":"https://openalex.org/keywords/electronic-structure","display_name":"electronic structure","score":0.4440000057220459},{"id":"https://openalex.org/keywords/band-gap-prediction","display_name":"band gap prediction","score":0.6600000262260437}],"concepts":[{"id":"https://openalex.org/C45206210","wikidata":"https://www.wikidata.org/wiki/Q2415817","display_name":"Nanoscopic scale","level":2,"score":0.8108533620834351},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.6138830184936523},{"id":"https://openalex.org/C121864883","wikidata":"https://www.wikidata.org/wiki/Q677916","display_name":"Statistical physics","level":1,"score":0.3721713423728943},{"id":"https://openalex.org/C171250308","wikidata":"https://www.wikidata.org/wiki/Q11468","display_name":"Nanotechnology","level":1,"score":0.27952492237091064},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.16236171126365662}],"mesh":[],"locations_count":1,"locations":[{"id":"mag:2240477367","doi":null,"is_oa":false,"landing_page_url":"http://absimage.aps.org/image/MAR14/MWS_MAR14-2013-003883.pdf","pdf_url":null,"source":{"id":"https://openalex.org/S2764664775","display_name":"Bulletin of the American Physical Society","issn_l":"0003-0503","issn":["0003-0503"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core"],"host_organization":"https://openalex.org/P4310311721","host_organization_name":"Cambridge University Press","host_organization_lineage":["https://openalex.org/P4310311721","https://openalex.org/P4310311702"],"host_organization_lineage_names":["Cambridge University Press","University of Cambridge"],"type":"journal"},"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false,"raw_source_name":"Bulletin of the American Physical Society","raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":0,"referenced_works":[],"related_works":["https://openalex.org/W2563457339","https://openalex.org/W2783863417","https://openalex.org/W2551761468","https://openalex.org/W2249942993","https://openalex.org/W2333967972","https://openalex.org/W4220743522","https://openalex.org/W1907797053","https://openalex.org/W3205469062","https://openalex.org/W3211709793","https://openalex.org/W2727915172"],"abstract_inverted_index":null,"counts_by_year":[],"updated_date":"2026-09-24T07:57:37.273135","created_date":"2016-06-24T00:00:00"}
